(3S)-3-methyl-4-(3-methylbut-2-enyl)-6-methylsulfanyl-1,2,3,5-tetrahydro-1,4-benzodiazepin-9-amine

Systemtic Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-6-methylsulfanyl-1,2,3,5-tetrahydro-1,4-benzodiazepin-9-amine Openeye Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-6-methylsulfanyl-1,2,3,5-tetrahydro-1,4-benzodiazepin-9-amine CAS Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-6-(methylthio)-1,2,3,5-tetrahydro-1,4-benzodiazepin-9-amine IUPAC Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-6-methylsulfanyl-1,2,3,5-tetrahydro-1,4-benzodiazepin-9-amine Traditional Name: [(3S)-3-methyl-4-(3-methylbut-2-enyl)-6-(methylthio)-1,2,3,5-tetrahydro-1,4-benzodiazepin-9-yl]amine Formula: C16H25N3S MolecularWeight: 291.4548

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC2=C(C=CC(=C2CN1CC=C(C)C)SC)N

Isomeric SMILES

C[C@H]1CNC2=C(C=CC(=C2CN1CC=C(C)C)SC)N

InChI

InChI=1S/C16H25N3S/c1-11(2)7-8-19-10-13-15(20-4)6-5-14(17)16(13)18-9-12(19)3/h5-7,12,18H,8-10,17H2,1-4H3/t12-/m0/s1